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Details

Stereochemistry ACHIRAL
Molecular Formula C3H9NO.2H2O
Molecular Weight 111.1402
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRIMETHYLAMINE OXIDE DIHYDRATE

SMILES

O.O.C[N+](C)(C)[O-]

InChI

InChIKey=PGFPZGKEDZGJQZ-UHFFFAOYSA-N
InChI=1S/C3H9NO.2H2O/c1-4(2,3)5;;/h1-3H3;2*1H2

HIDE SMILES / InChI

Molecular Formula H2O
Molecular Weight 18.0153
Charge 0
Count
MOL RATIO 2 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C3H9NO
Molecular Weight 75.1097
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

Substance Class Chemical
Record UNII
C73WZ0186W
Record Status Validated (UNII)
Record Version